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N-(4-chlorobenzyl)-N-[1-(4-iodophenyl)-2,5-dioxo-3-pyrrolidinyl]-N'-methylthiourea
SpectraBase Compound ID xtLvaQGcTl
InChI InChI=1S/C19H17ClIN3O2S/c1-22-19(27)23(11-12-2-4-13(20)5-3-12)16-10-17(25)24(18(16)26)15-8-6-14(21)7-9-15/h2-9,16H,10-11H2,1H3,(H,22,27)
InChIKey RITKBVHKZRMZBJ-UHFFFAOYSA-N
Mol Weight 513.78 g/mol
Molecular Formula C19H17ClIN3O2S
Exact Mass 512.977471 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FNZIDOP3Qtt
Name N-(4-chlorobenzyl)-N-[1-(4-iodophenyl)-2,5-dioxo-3-pyrrolidinyl]-N'-methylthiourea
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C19H17ClIN3O2S/c1-22-19(27)23(11-12-2-4-13(20)5-3-12)16-10-17(25)24(18(16)26)15-8-6-14(21)7-9-15/h2-9,16H,10-11H2,1H3,(H,22,27)
InChIKey RITKBVHKZRMZBJ-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_145
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: ZI/8092467; Labnumber: PE-0002987
Temperature 297 °C